File name: Pandora141s1_Calakmul_20240704_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T090649.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 141 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20240704_L1_smca1c3d20231011p1-8.txt Full location name: Calakmul Atmospheric Observatory Short location name: Calakmul Country of location: Mexico Location latitude [deg]: 18.5956 Location longitude [deg]: -89.4137 Location altitude [m]: 275 Local noon date: 20240704 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB session based on session 2 First and last pixel inside fitting window: 238 379 Nominal wavelengths inside fitting window [nm]: 305.1074 305.2483 305.3892 305.5302 305.6711 305.8120 305.9528 306.0937 306.2346 306.3754 306.5163 306.6571 306.7979 306.9387 307.0795 307.2203 307.3611 307.5018 307.6426 307.7833 307.9240 308.0647 308.2054 308.3461 308.4868 308.6275 308.7681 308.9088 309.0494 309.1900 309.3306 309.4712 309.6118 309.7524 309.8930 310.0335 310.1741 310.3146 310.4551 310.5956 310.7361 310.8766 311.0171 311.1575 311.2980 311.4384 311.5788 311.7192 311.8596 312.0000 312.1404 312.2808 312.4211 312.5615 312.7018 312.8421 312.9824 313.1227 313.2630 313.4033 313.5435 313.6838 313.8240 313.9643 314.1045 314.2447 314.3849 314.5251 314.6652 314.8054 314.9455 315.0857 315.2258 315.3659 315.5060 315.6461 315.7862 315.9262 316.0663 316.2063 316.3463 316.4864 316.6264 316.7664 316.9063 317.0463 317.1863 317.3262 317.4662 317.6061 317.7460 317.8859 318.0258 318.1657 318.3055 318.4454 318.5852 318.7250 318.8649 319.0047 319.1445 319.2842 319.4240 319.5638 319.7035 319.8433 319.9830 320.1227 320.2624 320.4021 320.5418 320.6814 320.8211 320.9607 321.1003 321.2400 321.3796 321.5192 321.6588 321.7983 321.9379 322.0774 322.2170 322.3565 322.4960 322.6355 322.7750 322.9145 323.0539 323.1934 323.3328 323.4723 323.6117 323.7511 323.8905 324.0299 324.1692 324.3086 324.4479 324.5873 324.7266 324.8659 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SU 20240704T134402.4Z 8951.572250 1791 1 30.12 2 60.07 73.86 43.58 68.25 0.00 1 0.00 1 0 17 1.149e-02 6.334e-03 5.691e-03 1.705e-03 2.491382e-01 9.128000e-04 2.698769e-03 -6.000000e+00 7.016071e-03 227.91 -2.00 3.11 -2.00 317.48 0.00e+00 2.618139e-04 1.419383e-04 1.271914e-04 -6.000000e+00 3.210179e-04 293.77 -2.00 20.00 -2.00 316.57 0.00e+00 1.995 0.000 302.00 328.00 3 4.5064e+00 2.4128e-03 2.2385e-02 -6.0000e+00 1.7354e-02 1.6709e-03 2.7128e-03 1.1550e-02 -6.0000e+00 1.8676e-02 1.2078e-02 1.6292e-03 5.6431e-03 -6.0000e+00 1.1205e-02 -9.2069e-03 8.0961e-04 1.5825e-03 -6.0000e+00 4.8524e-03 6.3390e-04 2.3326e-04 5.5495e-05 2.0990e-05 -6.0000e+00 3.5518e-04 -3.4272e-02 1.3272e-05 10 0 0 10 0 0 100.00 19.96 0.12 -0.03427 -0.03252 128 128 1 5 0 235.230 26.00 19.99 19.96 35.50 14.0 983.10 -1766 -2649 -543 -6667 -204 -1902 3500 -1130 187 -1571 -2574 1696 -505 1586 -583 1740 -1651 251 -346 -1802 819 -151 2071 163 1353 -337 -379 -253 1561 1939 1549 1993 324 -532 -1659 611 -1070 -428 -897 -1451 -740 -1908 -600 -849 -547 -723 -1171 -245 -351 447 -73 1465 381 975 460 808 388 61 608 563 2158 1357 1658 413 -358 17 464 1425 1210 1168 -243 139 -160 -200 351 53 843 364 451 -586 -1081 -1790 -1354 -1315 -1001 -702 -876 -118 -431 127 195 308 592 1217 924 533 601 -134 -714 -852 -412 -236 548 -6 -692 -552 -851 -23 113 656 -36 -349 -45 113 733 851 1241 500 185 -513 -346 -480 -268 110 6 642 967 1079 602 26 -396 -231 399 68 -10 -17 90 -471 -310 -275 -177 44 -182 -297 -60 -744 -20 -182 337 -126 23 -200 -336 221 -74 260 -109 345 -354 55 -79 -430 194 -36 500 42 363 -94 -105 -67 388 476 400 550 96 -161 -493 179 -344 -158 -386 -706 -386 -1050 -334 -479 -308 -406 -650 -132 -188 241 -42 865 239 631 308 550 268 42 415 386 1506 1009 1308 341 -295 13 342 1037 935 982 -220 129 -150 -181 298 42 616 261 336 -480 -972 -1739 -1382 -1402 -1121 -824 -1070 -147 -533 153 221 327 592 1199 951 592 720 -172 -953 -1126 -519 -282 637 -7 -875 -729 -1166 -32 166 999 -57 -553 -70 165 1011 1134 1654 691 269 -777 -532 -735 -401 160 8 868 1274 1434 837 38 -600 -357 626 111 -16 -29 160 -849 -559 -490 -308 74 SU 20240704T135718.1Z 8951.581460 1890 1 30.02 2 57.04 74.40 40.74 67.99 0.00 1 0.00 1 0 17 8.667e-03 5.955e-03 2.801e-03 1.108e-03 2.324558e-01 5.976614e-04 2.529773e-03 -6.000000e+00 5.293263e-03 227.91 -2.00 3.11 -2.00 316.80 0.00e+00 2.995956e-04 7.851811e-05 1.065668e-04 -6.000000e+00 2.421975e-04 293.77 -2.00 20.00 -2.00 315.91 0.00e+00 1.832 0.000 302.00 328.00 3 4.1099e+00 1.5611e-03 2.0639e-02 -6.0000e+00 1.3093e-02 3.8966e-03 1.7431e-03 1.0748e-02 -6.0000e+00 1.4090e-02 5.1044e-03 1.0226e-03 5.2569e-03 -6.0000e+00 8.4540e-03 -5.6604e-03 4.9106e-04 1.4788e-03 -6.0000e+00 3.6607e-03 1.1319e-03 2.9532e-04 3.5887e-05 2.0534e-05 -6.0000e+00 2.6798e-04 -3.3763e-02 2.0032e-05 11 1 0 11 8 0 99.98 19.96 0.20 -0.03376 -0.03154 105 105 1 5 0 285.870 26.00 19.99 19.96 36.00 14.0 983.04 -1074 -1816 -2238 -2368 -3219 -1336 18 1898 706 -153 -846 -811 1508 269 457 -701 -334 -106 470 -445 194 1084 1071 860 949 -201 -953 -277 1051 1137 1112 1987 70 -1229 -1558 -1120 -424 -461 -374 -1233 -1097 -1456 -973 -646 -505 -610 -827 -686 -114 461 616 943 724 869 718 841 549 366 551 991 1396 1586 1492 377 -87 12 -1 905 1120 941 196 -7 128 -110 -48 -47 -19 230 81 -485 -1201 -1720 -1616 -1364 -885 -612 -489 -193 -414 -223 -81 112 473 1032 694 615 485 -66 -584 -738 -491 -91 704 180 -791 -794 -668 -111 348 427 -29 30 -173 200 719 936 910 683 2 -365 -459 -326 -130 303 189 496 915 973 530 227 -309 -247 245 169 -211 -241 -121 -173 -207 -284 -172 -66 -158 -290 -361 -359 -449 -176 2 285 117 -27 -149 -148 298 61 116 -179 -89 -29 133 -131 58 319 322 272 315 -69 -325 -89 344 366 374 653 25 -445 -546 -390 -160 -204 -195 -682 -659 -920 -627 -418 -326 -391 -520 -420 -68 277 387 628 510 638 543 649 430 285 424 762 1109 1248 1261 335 -77 10 -1 734 900 839 190 -7 128 -107 -43 -38 -15 177 66 -407 -1130 -1778 -1660 -1478 -1018 -749 -590 -238 -508 -262 -95 119 497 1060 753 682 595 -83 -769 -956 -597 -109 818 217 -966 -1027 -903 -156 482 625 -44 47 -254 289 958 1185 1154 906 3 -550 -666 -496 -192 427 254 675 1198 1288 697 318 -454 -372 377 255 -336 -402 -208 -302 -361 -486 -285 -106 SU 20240704T140313.4Z 8951.585572 1899 1 4.77 2 55.69 74.62 39.47 67.82 0.00 1 0.00 1 0 17 1.439e-02 8.008e-03 1.162e-02 5.576e-03 2.282821e-01 3.007819e-03 2.487655e-03 -6.000000e+00 8.787476e-03 227.91 -2.00 3.11 -2.00 316.23 0.00e+00 3.888755e-04 3.466377e-04 3.450847e-05 -6.000000e+00 4.021159e-04 293.77 -2.00 20.00 -2.00 315.38 0.00e+00 1.769 0.000 302.00 328.00 3 5.3081e+00 7.7863e-03 2.0013e-02 -6.0000e+00 2.1735e-02 2.7818e-02 8.6590e-03 1.0534e-02 -6.0000e+00 2.3395e-02 -4.6566e-03 5.0079e-03 5.1503e-03 -6.0000e+00 1.4037e-02 -1.2036e-03 2.3516e-03 1.4658e-03 -6.0000e+00 6.0755e-03 3.6214e-04 -1.2432e-04 1.7806e-04 2.0480e-05 -6.0000e+00 4.4514e-04 -3.3561e-02 -8.6282e-05 12 9 1 12 1 1 999.00 19.96 0.24 -0.03356 -0.03450 2 19 1 5 0 1587.640 26.00 19.98 19.96 36.04 14.0 983.09 2502 -2491 -5593 2031 -6875 2416 -1939 1889 1851 -1332 529 -3588 -313 1019 -45 -2436 -402 -1300 1385 1522 -271 2280 -246 -267 3257 -303 -157 412 1342 2736 3929 1268 1135 -1779 -3861 -2559 -1278 219 648 -1573 -1684 -1617 -419 -1089 -361 -178 27 1481 -252 655 899 1357 638 -793 1041 311 1920 194 30 836 1809 771 513 615 -313 -939 841 1037 2045 556 -396 -877 9 -713 272 -364 -363 1159 -54 491 -810 -1255 -1600 -1120 -1060 -671 -301 -993 -531 723 10 405 -251 2873 123 175 281 -774 -770 -520 -806 359 1072 232 -503 -466 -731 -301 -34 474 -407 97 288 466 -247 1115 816 1251 -197 -329 21 -952 -219 249 408 776 1384 13 691 -214 -139 88 198 733 -124 -127 -157 -148 -374 -307 -717 25 454 -503 -1169 376 -1272 399 -350 362 384 -293 115 -836 -77 277 -14 -800 -135 -452 484 545 -100 825 -92 -104 1285 -125 -64 161 498 993 1463 511 479 -772 -1657 -1089 -576 110 366 -993 -1129 -1120 -293 -770 -254 -124 18 991 -169 439 622 976 480 -619 819 250 1535 157 24 669 1475 662 462 568 -289 -831 705 861 1765 518 -390 -888 9 -702 254 -321 -302 933 -45 439 -782 -1286 -1713 -1238 -1219 -801 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